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1050423-87-4

1050423-87-4 Structure

1050423-87-4 Structure
IdentificationBack Directory
[Name]

4-Carboxy-2-fluorophenylboronic acid pinacol ester
[CAS]

1050423-87-4
[Synonyms]

4-BORONO-3-FLUOROBENZOIC ACID PINACOL ESTER
4-Carboxy-2-fluorophenylboronic acid pinacol ester
4-Carboxy-2-fluorobenzeneboronic acid pinacol ester, 96%
3-Fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoic acid
Benzoic acid, 3-fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
[Molecular Formula]

C13H16BFO4
[MDL Number]

MFCD12756466
[MOL File]

1050423-87-4.mol
[Molecular Weight]

266.07
Chemical PropertiesBack Directory
[Melting point ]

199-204℃
[Boiling point ]

379.3±32.0 °C(Predicted)
[density ]

1.20±0.1 g/cm3(Predicted)
[storage temp. ]

Keep in dark place,Inert atmosphere,Room temperature
[form ]

Solid
[pka]

3.75±0.10(Predicted)
[Appearance]

White to off-white Solid
[InChI]

InChI=1S/C13H16BFO4/c1-12(2)13(3,4)19-14(18-12)9-6-5-8(11(16)17)7-10(9)15/h5-7H,1-4H3,(H,16,17)
[InChIKey]

JSQNZNXVVRPGTD-UHFFFAOYSA-N
[SMILES]

C(O)(=O)C1=CC=C(B2OC(C)(C)C(C)(C)O2)C(F)=C1
[CAS DataBase Reference]

1050423-87-4
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319-H335
[Precautionary statements ]

P261-P264-P271-P280-P302+P352-P305+P351+P338
[Hazard Codes ]

Xi
[Risk Statements ]

36/37/38
[Safety Statements ]

26
[WGK Germany ]

3
[HS Code ]

2931900090
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Hazard InformationBack Directory
[Uses]

4-Carboxy-2-fluorophenylboronic acid, pinacol ester
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